3-methyl-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(3-oxidanylpropyl)thiourea

Systemtic Name: 3-methyl-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(3-oxidanylpropyl)thiourea Openeye Name: 1-(3-hydroxypropyl)-3-methyl-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-(3-hydroxypropyl)-3-methyl-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 1-(3-hydroxypropyl)-3-methyl-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-(3-hydroxypropyl)-1-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]-3-methyl-thiourea Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCCO)C(=S)NC

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCCO)C(=S)NC

InChI

InChI=1S/C16H21N3O2S/c1-11-4-5-12-9-13(15(21)18-14(12)8-11)10-19(6-3-7-20)16(22)17-2/h4-5,8-9,20H,3,6-7,10H2,1-2H3,(H,17,22)(H,18,21)